2-(3-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile

Systemtic Name: 2-(3-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile Openeye Name: 2-(3-fluorophenyl)-2-(4-methylpiperazin-1-yl)acetonitrile CAS Name: 2-(3-fluorophenyl)-2-(4-methyl-1-piperazinyl)acetonitrile IUPAC Name: 2-(3-fluorophenyl)-2-(4-methylpiperazin-1-yl)acetonitrile Traditional Name: 2-(3-fluorophenyl)-2-(4-methylpiperazino)acetonitrile Formula: C13H16FN3 MolecularWeight: 233.284643

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(C#N)C2=CC(=CC=C2)F

Isomeric SMILES

CN1CCN(CC1)C(C#N)C2=CC(=CC=C2)F

InChI

InChI=1S/C13H16FN3/c1-16-5-7-17(8-6-16)13(10-15)11-3-2-4-12(14)9-11/h2-4,9,13H,5-8H2,1H3